input word = C00059559

Metabolite InformationStructural formula
Name 2,17-Didecarboxybetanidin
Formula C16H16N2O4
Mw 300.11100701
CAS RN 1286196-06-2
C_ID C00059559
InChIKey ZXPPNUYENJSSMO-LBPRGKRZSA-N
InChICode InChI=1S/C16H16N2O4/c19-14-8-11-3-6-18(13(11)9-15(14)20)5-2-10-1-4-17-12(7-10)16(21)22/h1-2,4-5,8-9,12,19-20H,3,6-7H2,(H,21,22)/t12-/m0/s1
SMILES O=C(O)C1CC(C=CN2CCc3cc(O)c(O)cc32)=CC=N1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCaryophyllalesBeta vulgaris Ref.
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